(7-Bromoheptyl)benzene

Basic Information

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CAS Number

78573-85-0

Molecular Formula

C13H19Br

Molecular Weight

255.2 g/mol

Chemical Classification

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

92-94°C

SMILES

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C1=CC=C(C=C1)CCCCCCCBr

InChI

InChI=1S/C13H19Br/c14-12-8-3-1-2-5-9-13-10-6-4-7-11-13/h4,6-7,10-11H,1-3,5,8-9,12H2

InChIKey

ASLQYSAHLPRDAY-UHFFFAOYSA-N

LogP

4.574500000000004

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

116

Safety Information

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Hazard Statement

Synonyms & References

English

FS-5202
SCHEMBL1773132
DTXSID90370825
1-bromo-7phenyl heptane
78573-85-0
Benzene, (7-bromoheptyl)-
AKOS015918759
FT-0641684
1-bromo-7-phenyl heptane
7-bromoheptylbenzene
(7-bromoheptyl)benzene
MFCD02093564
ASLQYSAHLPRDAY-UHFFFAOYSA-N
7-bromanylheptylbenzene
CS-0322436
1-bromo-7-phenyl-heptane
A839446
1-Bromo-7-phenylheptane
(7-Bromoheptyl)benzene
7-BROMOHEPTYLBENZENE
1-Brom-7-phenyl-heptan
7-phenyl-1-bromoheptane
7-Phenylheptyl bromide
Heptane,1-bromo-7-phenyl- (6CI)

MDL Number

MFCD02093564

Customs Code

2903999090

FAQ

What are the physical and chemical properties of (7-Bromoheptyl)benzene (CAS: 78573-85-0)?

(7-Bromoheptyl)benzene is a clear to slightly yellow liquid with a molecular weight of approximately 238.05 g/mol. It has a high boiling point and is only slightly soluble in water but soluble in organic solvents. The compound is reactive towards nucleophiles and can undergo bromination reactions efficiently.

How is (7-Bromoheptyl)benzene (CAS: 78573-85-0) typically synthesized?

(7-Bromoheptyl)benzene is typically synthesized by bromination of heptylbenzene using N-bromosuccinimide (NBS) in the presence of a radical initiator. The reaction is carried out in an inert solvent and under light or heat conditions to achieve good selectivity and high yield.

What industries use (7-Bromoheptyl)benzene (CAS: 78573-85-0)?

(7-Bromoheptyl)benzene is used in the pharmaceutical industry for the synthesis of certain compounds and in the semiconductor industry for the production of organic materials. It is also utilized in the development of sensors and as a building block in polymer chemistry.

What precautions should be taken when handling (7-Bromoheptyl)benzene (CAS: 78573-85-0)?

When handling (7-Bromoheptyl)benzene, it is important to use appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be performed in a fume hood to minimize inhalation risks. In case of a spill, neutralize any bromine fumes with sodium thiosulfate and clean up carefully following standard laboratory procedures. Always refer to the Material Safety Data Sheet (MSDS) for detailed safety information.